1-[(4-chlorophenyl)methyl]-3-(9H-xanthen-9-ylcarbonylamino)thiourea

Systemtic Name: 1-[(4-chlorophenyl)methyl]-3-(9H-xanthen-9-ylcarbonylamino)thiourea Openeye Name: 1-[(4-chlorophenyl)methyl]-3-(9H-xanthene-9-carbonylamino)thiourea CAS Name: 1-[(4-chlorophenyl)methyl]-3-[[oxo(9H-xanthen-9-yl)methyl]amino]thiourea IUPAC Name: 1-[(4-chlorophenyl)methyl]-3-(9H-xanthene-9-carbonylamino)thiourea Traditional Name: 1-(4-chlorobenzyl)-3-(9H-xanthene-9-carbonylamino)thiourea Formula: C22H18ClN3O2S MolecularWeight: 423.91522

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(C3=CC=CC=C3O2)C(=O)NNC(=S)NCC4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(C3=CC=CC=C3O2)C(=O)NNC(=S)NCC4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H18ClN3O2S/c23-15-11-9-14(10-12-15)13-24-22(29)26-25-21(27)20-16-5-1-3-7-18(16)28-19-8-4-2-6-17(19)20/h1-12,20H,13H2,(H,25,27)(H2,24,26,29)